SCHEMBL29928873

SCHEMBL29928873

Cc1cc(=O)oc2cc(NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)OCc3ccccc3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
TDP1 Q9NUW8 1/20 0.46
SIRT1 Q96EB6 6/20 0.46
SIRT2 Q8IXJ6 5/20 0.46
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 5/20 0.45
HPGD P15428 5/20 0.45
NPC1 O15118 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HSD17B10 Q99714 2/20 0.45
PTGER4 P35408 3/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL11355182 0.99 RAB9A (0.48) RAB9ATDP1SIRT1SIRT2KDM4E
SCHEMBL29401976 0.99 RAB9A (0.47) RAB9ATDP1SIRT1SIRT2KDM4E
SCHEMBL8344319 0.99 RAB9A (0.47) RAB9ATDP1SIRT1SIRT2KDM4E
Hydrochloric Acid SCHEMBL29501091 0.98 RAB9A (0.47) RAB9ATDP1SIRT1SIRT2KDM4E
Acetic Acid SCHEMBL30688430 0.97 RAB9A (0.46) RAB9ATDP1SIRT1SIRT2KDM4E
SCHEMBL29872228 0.96 SIRT2 (0.48) RAB9ATDP1SIRT1SIRT2
SCHEMBL31046113 0.95 RAB9A (0.44) RAB9ATDP1SIRT1SIRT2KDM4E
SCHEMBL10727549 0.94 SIRT2 (0.50) RAB9ATDP1SIRT1SIRT2KDM4E
Hydrochloric Acid SCHEMBL380911 0.93 SIRT2 (0.49) RAB9ATDP1SIRT1SIRT2KDM4E
SCHEMBL4727432 0.93 SIRT2 (0.49) RAB9ATDP1SIRT1SIRT2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114163531-B Tissue factor pathway inhibitor antibodies and uses thereof 辉瑞公司 2025-06-13 CN disclosed
CN-117916236-A Substituted S-alanine ester derivatives 拜耳公司 2024-04-19 CN disclosed
CN-117897391-A Method for preparing peptide library or peptide 洛桑联邦政府综合工科学校(EPFL) 2024-04-16 CN disclosed
CN-117881524-A Method for producing all-hydrophobic material with hierarchical structure and use thereof 麦克马斯特大学 2024-04-12 CN disclosed
CN-110330563-B Modified serine protease inhibitors for the treatment of hemorrhagic diseases 剑桥实业有限公司 2024-03-29 CN disclosed
CN-113292539-B Substituted oxopyridine derivatives 拜耳制药股份公司 2023-12-22 CN disclosed
CN-117015535-A (4S)-2 4 -chloro-4-ethyl-7 3 -fluoro-3 5 -methoxy-3 2 5-dioxo-1 4 - (trifluoromethyl) -3 2 H-6-aza-3 (4, 1) -pyridine-1 (1) - [1,2,3]Triazole-2 (1, 2), 7 (1) -5-diphenylheptane-7 4 Crystalline forms of formamide 拜耳公司 2023-11-07 CN disclosed
CN-111718396-B Synthetic peptides, pharmaceutical compositions comprising the same, and their use in treating disease associated with embolism 刘扶东 2022-09-16 CN disclosed